Ethanol → HCID 22261691, compound

HRID 150051Notes

Reaction equation

HRID 150051 reaction equation
[CH2:32]([OH:33])[CH3:34].[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH2:15][c:16]2[cH:17][cH:18][c:19]([C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])([F:27])[F:28])[cH:20][cH:21]2)[OH:29])[cH:5][cH:6][cH:7]1.[Na+:31].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH-:30]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH:9]([C:10](=[O:11])[OH:12])[CH2:15][c:16]2[cH:17][cH:18][c:19]([C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])([F:27])[F:28])[cH:20][cH:21]2)[OH:29])[cH:5][cH:6][cH:7]1

Participants

6

Sources & evidence

ORD record
ord-4d126e74f3074516822e68294efdcb92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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